⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL13058882 | 0.85 | PTGS1 (0.32) | — | |
| SCHEMBL19978377 | 0.84 | MAOA (0.37) | — | |
| SCHEMBL23350918 | 0.79 | — | — | |
| SCHEMBL20131067 | 0.79 | — | — | |
| SCHEMBL8053197 | 0.77 | MAOA (0.43) | — | |
| SCHEMBL26780609 | 0.72 | PTGS1 (0.33) | — | |
| SCHEMBL20900739 | 0.72 | — | — | |
| SCHEMBL31355576 | 0.72 | LMNA (0.36) | — | |
| SCHEMBL4605739 | 0.72 | LMNA (0.36) | — | |
| SCHEMBL19834678 | 0.72 | MAOA (0.42) | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10662214-B2 | Compound of 4′-thionucleoside, as well as preparation method therefor, pharmaceutical composition thereof and application thereof | Sichuan Keiun-Biotech Biopharmaceutical Co., Ltd. (CN) | 2020-05-26 | — | — | US | disclosed |
| US-20180079770-A1 | NOVEL COMPOUND OF 4'-THIONUCLEOSIDE, AS WELL AS PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF AND APPLICATION THEREOF | SICHUAN KELUN-BIOTECH BIOPHARMACEUTICAL CO., LTD. (CN) | 2018-03-22 | — | — | US | disclosed |
| US-20180079770-A1 | NOVEL COMPOUND OF 4'-THIONUCLEOSIDE, AS WELL AS PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF AND APPLICATION THEREOF | SICHUAN KELUN-BIOTECH BIOPHARMACEUTICAL CO., LTD. (CN) | 2018-03-22 | — | — | US | disclosed |